N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride

C13H20ClN3O2 — CID 119714183

IUPACN-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride
SMILESCCNC(=O)c1ccc(NC(=O)CNC)c(C)c1.Cl
InChIInChI=1S/C13H19N3O2.ClH/c1-4-15-13(18)10-5-6-11(9(2)7-10)16-12(17)8-14-3;/h5-7,14H,4,8H2,1-3H3,(H,15,18)(H,16,17);1H
InChIKeyLEFBSCVMBPLHHC-UHFFFAOYSA-N
MW285.78 g/mol
LogP1.32
Rot. Bonds5

About N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride

N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride (PubChem CID 119714183) has the molecular formula C13H20ClN3O2 and a molecular weight of 285.78 g/mol. Its IUPAC name is N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride.

Molecular Properties

Compound NameN-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride
PubChem CID119714183
Molecular FormulaC13H20ClN3O2
Molecular Weight285.78 g/mol
Exact Mass285.12
IUPAC NameN-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride
SMILESCCNC(=O)c1ccc(NC(=O)CNC)c(C)c1.Cl
InChIInChI=1S/C13H19N3O2.ClH/c1-4-15-13(18)10-5-6-11(9(2)7-10)16-12(17)8-14-3;/h5-7,14H,4,8H2,1-3H3,(H,15,18)(H,16,17);1H
InChIKeyLEFBSCVMBPLHHC-UHFFFAOYSA-N
XLogP1.32
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.78
LogP ≤ 51.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-aminopropanoylamino)-N-ethyl-3-methylbenzamide
CID 54862801
N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride
CID 119714198
N-ethyl-3-methyl-4-[[2-methyl-2-(methylamino)propanoyl]amino]benzamide
CID 62848154
4-(butanoylamino)-N,3-dimethylbenzamide
CID 61216786
4-[[2-(2-aminoethoxy)acetyl]amino]-N-ethyl-3-methylbenzamide
CID 79473931
N-ethyl-3-methyl-4-(2-methylpropylcarbamoylamino)benzamide
CID 47264617
4-[(3-chloro-2,2-dimethylpropanoyl)amino]-N-ethyl-3-methylbenzamide
CID 63681118
4-(ethylamino)-3-methyl-N-[2-(methylamino)-2-oxoethyl]benzamide
CID 55163644
4-[[(2S)-2-amino-3,3-dimethylbutanoyl]amino]-N-ethyl-3-methylbenzamide
CID 61179048
3-methyl-N-[2-(methylamino)ethyl]-4-(3-methylbutanoylamino)benzamide
CID 119503824
4-[2-methyl-4-(methylcarbamoyl)anilino]-4-oxobutanoic acid
CID 54868212
4-[2-(aminomethyl)pentanoylamino]-N-ethyl-3-methylbenzamide
CID 65229718

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride?
The IUPAC name of N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride (CID 119714183) is N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride.
What is the SMILES notation for N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride?
The canonical SMILES for N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride is CCNC(=O)c1ccc(NC(=O)CNC)c(C)c1.Cl.
What is the InChIKey of N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride?
The InChIKey is LEFBSCVMBPLHHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2.ClH/c1-4-15-13(18)10-5-6-11(9(2)7-10)16-12(17)8-14-3;/h5-7,14H,4,8H2,1-3H3,(H,15,18)(H,16,17);1H.
What are the key properties of N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride?
N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride has a molecular weight of 285.78 g/mol, XLogP of 1.32, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride is sourced from PubChem (CID 119714183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).